2-[[2,2-dimethyl-3-(phenylcarbonylsulfanyl)propanoyl]amino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[[2,2-dimethyl-3-(phenylcarbonylsulfanyl)propanoyl]amino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[(3-benzoylsulfanyl-2,2-dimethyl-propanoyl)amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[3-(benzoylthio)-2,2-dimethyl-1-oxopropyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[(3-benzoylsulfanyl-2,2-dimethylpropanoyl)amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[3-(benzoylthio)-2,2-dimethyl-propanoyl]amino]-3-(methylthio)propionic acid Formula: C16H21NO4S2 MolecularWeight: 355.47224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSC(=O)C1=CC=CC=C1)C(=O)NC(CSC)C(=O)O

Isomeric SMILES

CC(C)(CSC(=O)C1=CC=CC=C1)C(=O)NC(CSC)C(=O)O

InChI

InChI=1S/C16H21NO4S2/c1-16(2,15(21)17-12(9-22-3)13(18)19)10-23-14(20)11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,19)